(2S,3S,4S)-3-chloranyl-2-(4-methoxyphenyl)-3-nitro-8-prop-2-enyl-2,4-dihydrochromen-4-ol

Systemtic Name: (2S,3S,4S)-3-chloranyl-2-(4-methoxyphenyl)-3-nitro-8-prop-2-enyl-2,4-dihydrochromen-4-ol Openeye Name: (2S,3S,4S)-8-allyl-3-chloro-2-(4-methoxyphenyl)-3-nitro-chroman-4-ol CAS Name: (2S,3S,4S)-3-chloro-2-(4-methoxyphenyl)-3-nitro-8-prop-2-enyl-3,4-dihydro-2H-1-benzopyran-4-ol IUPAC Name: (2S,3S,4S)-3-chloro-2-(4-methoxyphenyl)-3-nitro-8-prop-2-enyl-2,4-dihydrochromen-4-ol Traditional Name: (2S,3S,4S)-8-allyl-3-chloro-2-(4-methoxyphenyl)-3-nitro-chroman-4-ol Formula: C19H18ClNO5 MolecularWeight: 375.80292

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(C(C3=C(O2)C(=CC=C3)CC=C)O)([N+](=O)[O-])Cl

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2[C@@]([C@H](C3=C(O2)C(=CC=C3)CC=C)O)([N+](=O)[O-])Cl

InChI

InChI=1S/C19H18ClNO5/c1-3-5-12-6-4-7-15-16(12)26-18(19(20,17(15)22)21(23)24)13-8-10-14(25-2)11-9-13/h3-4,6-11,17-18,22H,1,5H2,2H3/t17-,18-,19+/m0/s1